Molecular Properties | |
SMILES: | O=C(Cc1cccs1)N1CCN(S(=O)(=O)F)CC1 |
MW: | 292.04 |
Fraction sp3: | 0.5 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 57.69 |
cLogP: | 0.65 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
Source | |
Enamine BB: | EN300-26585948 |
Enamine SCR: | Z3624342044 |
Enamine REAL: | Z3637082672 |
Enamine Extended REAL: | m_22____15796012____58869 |
Mcule: | MCULE-2761789321 |
MolPort: | MolPort-046-729-581 |
halogen_heteroatom
sulfonyl_halide
Acyl halides and analogues
Halogen-bonded heteroatoms
Filter2_acyl_phosphyl_sulfonyl_halide
Filter25_sulfonyl_halide
Filter47_so2f
sufonyl halide
acid halide
P/S halide
Hetero_hetero
P_or_S_Halides
Phosphorus_Halide
Sulphur_Halide
LON-WEI-8f408cad-4
SAD-SAT-2fd372d1-4
0.393
MAR-TRE-6a44bbf2-52
0.391
AAR-POS-d2a4d1df-22
0.391
LON-WEI-8f408cad-3
0.391
SAD-SAT-2fd372d1-8
0.387
SAD-SAT-2fd372d1-10
0.378
LON-WEI-8f408cad-5
0.375
AAR-POS-0daf6b7e-17
0.375
SAD-SAT-2fd372d1-2
0.358
MAK-UNK-6435e6c2-2
0.355
MAK-UNK-6435e6c2-1
0.349
MAR-TRE-dab8f6ea-4
0.349
SAD-SAT-2fd372d1-7
0.348
BEN-DND-76ad4ac9-13
0.347
BEN-DND-03406596-5
0.347
MAR-TRE-6a44bbf2-21
0.338
MAK-UNK-7c9d1431-9
0.338
MAK-UNK-10dfa458-2
0.333
DRR-IMP-dff87f5e-6
0.333
JAG-SYN-9c2cd0bd-13
0.329
MAR-TRE-6a44bbf2-58
0.328
KAY-MCD-d0fe5261-1
0.328
MAK-UNK-10dfa458-4
0.328
MAT-POS-ee51dedd-2
0.328
MAK-UNK-10dfa458-21
0.328
PEI-IMP-ca0b2813-2
0.328
BEN-DND-03ad4429-7
0.328
DRR-IMP-dff87f5e-1
0.328
SAD-SAT-3a925b8b-2
0.328
LON-WEI-8f408cad-2
0.324
MAK-UNK-10dfa458-26
0.324
AAR-POS-d2a4d1df-32
0.324
MAR-TRE-6a44bbf2-4
0.324
LON-WEI-8f408cad-4
0.319
DAN-MCD-50ec7d1f-1
0.319
AAR-POS-d2a4d1df-23
0.319
BEN-DND-03406596-10
0.319
MAR-TRE-6a44bbf2-18
0.319
DRR-IMP-dff87f5e-3
0.313
AAR-POS-d2a4d1df-44
0.313
BEN-DND-03ad4429-8
0.312
AAR-POS-d2a4d1df-27
0.309
MAR-TRE-6a44bbf2-68
0.309
MAR-LAB-efb042c5-5
0.309
DRR-IMP-dff87f5e-7
0.309
NIM-UNI-05f93fcc-13
0.308
IND-SYN-6c8299e8-2
0.307
MAK-UNK-7c9d1431-13
0.304
SAD-SAT-3a925b8b-3
0.304
MAR-TRE-6a44bbf2-78
0.304
MAK-UNK-b1d4dcd7-2
0.303
AAR-POS-0daf6b7e-16
0.303
DRR-IMP-dff87f5e-4
0.299
BEN-DND-03406596-8
0.297
KEN-MCD-6084b33e-1
0.297
PEI-IMP-ca0b2813-1
0.296
MAK-UNK-987948f6-15
0.296
MAK-UNK-7c9d1431-17
0.296
MAR-TRE-6a44bbf2-8
0.296
AAR-POS-d2a4d1df-34
0.296
MAK-UNK-7c9d1431-6
0.296
MAK-UNK-7c9d1431-27
0.296
DRR-IMP-dff87f5e-9
0.296
MAK-UNK-c74072e5-8
0.296
DRR-IMP-dff87f5e-5
0.296
BEN-DND-03406596-2
0.293
BEN-DND-76ad4ac9-12
0.293
MAK-UNK-7c9d1431-10
0.292
MAR-TRE-6a44bbf2-32
0.292
ABB-MCD-f8003a30-1
0.292
ZAC-MCD-2bc172dc-1
0.292
DRR-IMP-dff87f5e-8
0.292
SAD-SAT-f2e2579e-8
0.291
AAR-POS-0daf6b7e-15
0.290
BEN-DND-03406596-3
0.289
BEN-DND-76ad4ac9-14
0.289
IND-SYN-6c8299e8-7
0.287
NAU-LAT-64f4b287-1
0.287
JAY-UNK-11f5bdbd-1
0.286
NIM-UNI-05f93fcc-1
0.286
BEN-DND-76ad4ac9-1
0.286
MAT-POS-ea426761-45
0.286
LON-WEI-5e7d1b3e-25
0.286
LON-WEI-4d77710c-25
0.286
MAR-TRE-6a44bbf2-28
0.286
MAK-UNK-7c9d1431-23
0.286
MAK-UNK-7c9d1431-12
0.286
WAR-XCH-b6889685-46
0.286
MAK-UNK-7c9d1431-22
0.284
MAK-UNK-3f402c2b-26
0.284
MAK-UNK-7264f48c-2
0.282
NIM-UNI-05f93fcc-2
0.282
KAT-UNK-48001bce-1
0.282
KAT-MCD-525c981a-1
0.282
MAK-UNK-b1d4dcd7-3
0.281
NIM-UNI-05f93fcc-10
0.280
TAT-ENA-80bfd3e5-43
0.280
MAR-TRE-6a44bbf2-65
0.280
MAK-UNK-7c9d1431-11
0.280
PEI-IMP-3d837503-4
0.279